N-(1,3-benzodioxol-5-ylmethyl)-4-(3-methoxyphenyl)-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(3-methoxyphenyl)-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(3-methoxyphenyl)-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(3-methoxyphenyl)-1-(4-methoxyphenyl)sulfonyl-3-pyrrolidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(3-methoxyphenyl)-1-(4-methoxyphenyl)sulfonylpyrrolidine-3-carboxamide Traditional Name: 4-(3-methoxyphenyl)-1-(4-methoxyphenyl)sulfonyl-N-piperonyl-pyrrolidine-3-carboxamide Formula: C27H28N2O7S MolecularWeight: 524.58542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CC(C(C2)C(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC(=CC=C5)OC

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CC(C(C2)C(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC(=CC=C5)OC

InChI

InChI=1S/C27H28N2O7S/c1-33-20-7-9-22(10-8-20)37(31,32)29-15-23(19-4-3-5-21(13-19)34-2)24(16-29)27(30)28-14-18-6-11-25-26(12-18)36-17-35-25/h3-13,23-24H,14-17H2,1-2H3,(H,28,30)